6-[[2-(chloromethyloxycarbonylamino)-2-(4-hydroxyphenyl)ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: 6-[[2-(chloromethyloxycarbonylamino)-2-(4-hydroxyphenyl)ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: 6-[[2-(chloromethoxycarbonylamino)-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-[[2-[[chloromethoxy(oxo)methyl]amino]-2-(4-hydroxyphenyl)-1-oxoethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate IUPAC Name: 6-[[2-(chloromethoxycarbonylamino)-2-(4-hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-[[2-(chloromethoxycarbonylamino)-2-(4-hydroxyphenyl)acetyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Formula: C18H19ClN3O7S- MolecularWeight: 456.87736

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)OCCl)C(=O)[O-])C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)NC(=O)OCCl)C(=O)[O-])C

InChI

InChI=1S/C18H20ClN3O7S/c1-18(2)12(16(26)27)22-14(25)11(15(22)30-18)20-13(24)10(21-17(28)29-7-19)8-3-5-9(23)6-4-8/h3-6,10-12,15,23H,7H2,1-2H3,(H,20,24)(H,21,28)(H,26,27)/p-1